Cas no 609788-39-8 (Benzonitrile, 4-bromo-2-methoxy-5-methyl-)
609788-39-8 structure
Product Name:Benzonitrile, 4-bromo-2-methoxy-5-methyl-
CAS No:609788-39-8
MF:C9H8BrNO
MW:226.06992149353
CID:1624318
Update Time:2024-09-12
Benzonitrile, 4-bromo-2-methoxy-5-methyl- Chemical and Physical Properties
Names and Identifiers
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- Benzonitrile, 4-bromo-2-methoxy-5-methyl-
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- Inchi： 1S/C9H8BrNO/c1-6-3-7(5-11)9(12-2)4-8(6)10/h3-4H,1-2H3
- InChI Key： HHCXYOYQTRBZGA-UHFFFAOYSA-N
- SMILES： C(#N)C1=CC(C)=C(Br)C=C1OC
Computed Properties
- Exact Mass: 224.97894
Experimental Properties
- Density: 1.49±0.1 g/cm3(Predicted)
- Boiling Point: 315.8±37.0 °C(Predicted)
- PSA: 33.02
Benzonitrile, 4-bromo-2-methoxy-5-methyl- Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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